General Information of the Compound
| Compound ID |
CP0565381
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| Compound Name |
N-[2-(2,5-difluorophenyl)pyridin-4-yl]-7-(2,4-dimethoxyphenyl)quinolin-4-amine
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| Formula |
C28H21F2N3O2
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| Molecular Weight |
469.491
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| Canonical SMILES |
COc1ccc(c(OC)c1)-c1ccc2c(Nc3ccnc(c3)-c3cc(F)ccc3F)ccnc2c1
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| InChI |
InChI=1S/C28H21F2N3O2/c1-34-20-5-7-21(28(16-20)35-2)17-3-6-22-25(10-12-32-26(22)13-17)33-19-9-11-31-27(15-19)23-14-18(29)4-8-24(23)30/h3-16H,1-2H3,(H,31,32,33)
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| InChIKey |
YYCOYNCWMSPDME-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound